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Methyl 2-oxo-1-cycloheptanecarboxylate

View entire compound with spectra: 2 NMR, 1 FTIR, and 3 MS (GC)

Methyl 2-oxo-1-cycloheptanecarboxylate
SpectraBase Compound ID 28Bt6YBWsaV
InChI InChI=1S/C9H14O3/c1-12-9(11)7-5-3-2-4-6-8(7)10/h7H,2-6H2,1H3
InChIKey BLNHITXSJKCQGZ-UHFFFAOYSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 10GtHGCgQEe
Name Methyl 2-oxo-1-cycloheptanecarboxylate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 298719
CAS Registry Number 52784-32-4
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-12-9(11)7-5-3-2-4-6-8(7)10/h7H,2-6H2,1H3
InChIKey BLNHITXSJKCQGZ-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_005792